Marius Stan

Mario Doumet, Marius Stan, Mathew Hall et al.

Convolutional Neural Networks (CNNs) combine large amounts of parallelizable computation with frequent memory access. Field Programmable Gate Arrays (FPGAs) can achieve low latency and high throughput CNN inference by implementing dataflow accelerators that pipeline layer-specific hardware to implement an entire network. By implementing a different processing element for each CNN layer, these layer-pipelined accelerators can achieve high compute density, but having all layers processing in parallel requires high memory bandwidth. Traditionally this has been satisfied by storing all weights on chip, but this is infeasible for the largest CNNs, which are often those most in need of acceleration. In this work we augment a state-of-the-art dataflow accelerator (HPIPE) to leverage both High-Bandwidth Memory (HBM) and on-chip storage, enabling high performance layer-pipelined dataflow acceleration of large CNNs. Based on profiling results of HBM's latency and throughput against expected address patterns, we develop an algorithm to choose which weight buffers should be moved off chip and how deep the on-chip FIFOs to HBM should be to minimize compute unit stalling. We integrate the new hardware generation within the HPIPE domain-specific CNN compiler and demonstrate good bandwidth efficiency against theoretical limits. Compared to the best prior work we obtain speed-ups of at least 19.4x, 5.1x and 10.5x on ResNet-18, ResNet-50 and VGG-16 respectively.

Jessica Pan, Joseph A. Libera, Noah H. Paulson et al.

Flame spray pyrolysis (FSP) is a process used to synthesize nanoparticles through the combustion of an atomized precursor solution; this process has applications in catalysts, battery materials, and pigments. Current limitations revolve around understanding how to consistently achieve a stable flame and the reliable production of nanoparticles. Machine learning and artificial intelligence algorithms that detect unstable flame conditions in real time may be a means of streamlining the synthesis process and improving FSP efficiency. In this study, the FSP flame stability is first quantified by analyzing the brightness of the flame's anchor point. This analysis is then used to label data for both unsupervised and supervised machine learning approaches. The unsupervised learning approach allows for autonomous labelling and classification of new data by representing data in a reduced dimensional space and identifying combinations of features that most effectively cluster it. The supervised learning approach, on the other hand, requires human labeling of training and test data, but is able to classify multiple objects of interest (such as the burner and pilot flames) within the video feed. The accuracy of each of these techniques is compared against the evaluations of human experts. Both the unsupervised and supervised approaches can track and classify FSP flame conditions in real time to alert users of unstable flame conditions. This research has the potential to autonomously track and manage flame spray pyrolysis as well as other flame technologies by monitoring and classifying the flame stability.

Maksim Levental, Ryan Chard, Joseph A. Libera et al.

Flame Spray Pyrolysis (FSP) is a manufacturing technique to mass produce engineered nanoparticles for applications in catalysis, energy materials, composites, and more. FSP instruments are highly dependent on a number of adjustable parameters, including fuel injection rate, fuel-oxygen mixtures, and temperature, which can greatly affect the quality, quantity, and properties of the yielded nanoparticles. Optimizing FSP synthesis requires monitoring, analyzing, characterizing, and modifying experimental conditions.Here, we propose a hybrid CPU-GPU Difference of Gaussians (DoG)method for characterizing the volume distribution of unburnt solution, so as to enable near-real-time optimization and steering of FSP experiments. Comparisons against standard implementations show our method to be an order of magnitude more efficient. This surrogate signal can be deployed as a component of an online end-to-end pipeline that maximizes the synthesis yield.

Ganesh Sivaraman, Leighanne Gallington, Anand Narayanan Krishnamoorthy et al.

Understanding the structure and properties of refractory oxides are critical for high temperature applications. In this work, a combined experimental and simulation approach uses an automated closed loop via an active-learner, which is initialized by X-ray and neutron diffraction measurements, and sequentially improves a machine-learning model until the experimentally predetermined phase space is covered. A multi-phase potential is generated for a canonical example of the archetypal refractory oxide, HfO2, by drawing a minimum number of training configurations from room temperature to the liquid state at ~2900oC. The method significantly reduces model development time and human effort.

Ganesh Sivaraman, Anand Narayanan Krishnamoorthy, Matthias Baur et al.

We propose a novel active learning scheme for automatically sampling a minimum number of uncorrelated configurations for fitting the Gaussian Approximation Potential (GAP). Our active learning scheme consists of an unsupervised machine learning (ML) scheme coupled to Bayesian optimization technique that evaluates the GAP model. We apply this scheme to a Hafnium dioxide (HfO2) dataset generated from a melt-quench ab initio molecular dynamics (AIMD) protocol. Our results show that the active learning scheme, with no prior knowledge of the dataset is able to extract a configuration that reaches the required energy fit tolerance. Further, molecular dynamics (MD) simulations performed using this active learned GAP model on 6144-atom systems of amorphous and liquid state elucidate the structural properties of HfO2 with near ab initio precision and quench rates (i.e. 1.0 K/ps) not accessible via AIMD. The melt and amorphous x-ray structural factors generated from our simulation are in good agreement with experiment. Additionally, the calculated diffusion constants are in good agreement with previous ab initio studies.